2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide
TL;DR: 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide (CAS 63869-43-2) is a chemical compound with molecular formula C21H26BrNO2 and molecular weight 403.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,9S,13S)-13-methyl-10-(2-phenylethyl)-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-triene-4,13-diol;hydrobromide
Also Known As: 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide, alpha-2',9-Dihydroxy-5-methyl-2(N)-phenethyl-6,7-benzomorphan hydrochloride, (2S,6S,11S)-11-Methyl-3-(2-phenylethyl)-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocine-8,11-diol--hydrogen bromide (1/1), 2,6-Methano-3-benzazocine-8,11-diol, 1,2,3,4,5,6-hexahydro-11-methyl-3-(2-phenylethyl)-, hydrobromide, (2.alpha.,6.alpha.,11S*)-, RefChem:248623
| Molecular Formula | C21H26BrNO2 |
|---|---|
| Molecular Weight | 403.11 g/mol |
| LogP | 3.6778 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 403.1147 |
| Heavy Atoms | 25 |
| Complexity | 731.93085 |
Chemical Identifiers
| CAS Number | 63869-43-2 |
|---|---|
| SMILES | C[C@@]1([C@H]2CCN([C@H]1CC3=C2C=C(C=C3)O)CCC4=CC=CC=C4)O.Br |
Product Overview
2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide (CAS 63869-43-2), with molecular formula C21H26BrNO2 and molecular weight 403.11 g/mol. IUPAC: (1S,9S,13S)-13-methyl-10-(2-phenylethyl)-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-triene-4,13-diol;hydrobromide.
Chemical Property Profile of 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide
Property Insights of 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide
The XLogP value of 3.6778 indicates that 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide?
The CAS number of 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide is 63869-43-2.
What is the molecular formula of 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide?
The molecular formula of 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide is C21H26BrNO2.
What is the molecular weight of 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide?
The molecular weight of 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide is 403.11 g/mol.
Where can I buy 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide?
You can request a quote for 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Methano-3-benzazocine-8,11-beta-diol, 1,2,3,4,5,6-hexahydro-11-alpha-methyl-, 3-phenethyl-, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.